Chem
J-GLOBAL ID：201407095470814870   Nikkaji number：J3.225.620A

PF-4620110

4β-[4-[5,6,7,8-テトラヒドロ-4-アミノ-5-オキソ-6-アザオキセピノ[2,3-d]ピリミジン-6-イル]フェニル]シクロヘキサン-1α-酢酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C21H24N4O4
Molecular formula furigana： C21-H24-N4-O4
Molecular weight： 396.447
InChI： InChI=1S/C21H24N4O4/c22-19-18-20(24-12-23-19)29-10-9-25(21(18)28)16-7-5-15(6-8-16)14-3-1-13(2-4-14)11-17(26)27/h5-8,12-14H,1-4,9-11H2,(H,26,27)(H2,22,23,24)/t13-,14-
InChI key： GEVVQZHMFVFGLN-HDJSIYSDSA-N
SMILES： Nc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(=O)O)CC3)C(=O)c12
Systematic name  (4)：
  • 4β-[4-[5,6,7,8-テトラヒドロ-4-アミノ-5-オキソ-6-アザオキセピノ[2,3-d]ピリミジン-6-イル]フェニル]シクロヘキサン-1α-酢酸
  • [4β-[4-(4-アミノ-5-オキソ-7,8-ジヒドロ-6H-9-オキサ-1,3,6-トリアザ-5H-ベンゾシクロヘプテン-6-イル)フェニル]シクロヘキサン-1α-イル]酢酸
  • 2-[(1r,4r)-4-(4-{4-アミノ-5-オキソ-5H,6H,7H,8H-ピリミド[5,4-f][1,4]オキサゼピン-6-イル}フェニル)シクロヘキシル]酢酸
  • 2-[(1r,4r)-4-(4-{4-amino-5-oxo-5H,6H,7H,8H-pyrimido[5,4-f][1,4]oxazepin-6-yl}phenyl)cyclohexyl]acetic acid
Other name (4)：
  • 4β-[4-[5,6,7,8-Tetrahydro-4-amino-5-oxo-6-azaoxepino[2,3-d]pyrimidine-6-yl]phenyl]cyclohexane-1α-acetic acid
  • PF-4620110
  • [4β-[4-(4-Amino-5-oxo-7,8-dihydro-6H-9-oxa-1,3,6-triaza-5H-benzocycloheptene-6-yl)phenyl]cyclohexane-1α-yl]acetic acid
  • PF-04620110
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